1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine

C16H18N4 — CID 103385789

IUPAC1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
SMILESCC(CNc1nccc2c1ncn2C)c1ccccc1
InChIInChI=1S/C16H18N4/c1-12(13-6-4-3-5-7-13)10-18-16-15-14(8-9-17-16)20(2)11-19-15/h3-9,11-12H,10H2,1-2H3,(H,17,18)
InChIKeyALDRKLNJIIEMQC-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.18
Rot. Bonds4

About 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine

1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine (PubChem CID 103385789) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
PubChem CID103385789
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
SMILESCC(CNc1nccc2c1ncn2C)c1ccccc1
InChIInChI=1S/C16H18N4/c1-12(13-6-4-3-5-7-13)10-18-16-15-14(8-9-17-16)20(2)11-19-15/h3-9,11-12H,10H2,1-2H3,(H,17,18)
InChIKeyALDRKLNJIIEMQC-UHFFFAOYSA-N
XLogP3.18
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine?
The IUPAC name of 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine (CID 103385789) is 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine is CC(CNc1nccc2c1ncn2C)c1ccccc1.
What is the InChIKey of 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine?
The InChIKey is ALDRKLNJIIEMQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-12(13-6-4-3-5-7-13)10-18-16-15-14(8-9-17-16)20(2)11-19-15/h3-9,11-12H,10H2,1-2H3,(H,17,18).
What are the key properties of 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine?
1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine has a molecular weight of 266.35 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103385789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).